SCHEMBL5734992

SCHEMBL5734992

Cc1nsc(NC(=O)C(C)c2ccc(O)c(NC(=O)CC(F)(F)F)c2)c1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 4/20 0.33
HTT P42858 4/20 0.33
MAPT P10636 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 2/20 0.33
TSHR P16473 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
POLB P06746 1/20 0.33
TP53 P04637 2/20 0.32
NPC1 O15118 1/20 0.32
TRPV1 Q8NER1 2/20 0.32
USP36 Q9P275 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3042064 0.79 ALDH1A1 (0.40) GAAMEN1KMT2AHPGDLMNA
SCHEMBL5736347 0.76 MAPT (0.44) GAAMEN1KMT2ALMNAHTT
Bromide SCHEMBL8001925 0.74 MAPT (0.42) GAAMEN1KMT2ALMNAHTT
SCHEMBL5735982 0.73 MAOA (0.37) GAAHPGDMAPTSMN1; SMN2RAB9A
Water SCHEMBL7984015 0.73 KMT2A (0.39) GAAMEN1KMT2ALMNAHTT
SCHEMBL8001928 0.72 MAPT (0.41) GAAMEN1KMT2ALMNAHTT
SCHEMBL5735580 0.69 ACLY (0.39) GAAHPGDMAPTSMN1; SMN2RAB9A
SCHEMBL3036063 0.68 ALDH1A1 (0.40) GAAHPGDHTTMAPTRAB9A
SCHEMBL7998396 0.66 RAB9A (0.41) GAAMEN1KMT2AHTTMAPT
SCHEMBL6614428 0.65 KMT2A (0.37) GAAMEN1KMT2AHPGDLMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1686128-A2 Isothiazole derivatives and their use as pesticides Syngenta Limited (GB) 2006-08-02 EP disclosed
EP-1265892-B1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LTD (GB) 2006-01-18 EP disclosed
US-6703347-B2 INSECTICIDES, FUNGICIDES, NEMATOCIDES, MOLLUSCICIDES, AND MITICIDES FOR PLANTS SYNGENTA LIMITED (GB) 2004-03-09 US disclosed
US-20030207926-A1 Isothiazole derivatives and their use as pesticides SYNGENTA LIMITED (GB) 2003-11-06 US disclosed
EP-1265892-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES Syngenta Limited (GB) 2002-12-18 EP disclosed
WO-2001055144-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed
WO-2001055139-A1 ISOTHIAZOLE DERIVATIVES AND THEIR USE AS PESTICIDES SYNGENTA LIMITED (GB) 2001-08-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030207926-A1 Isothiazole derivatives and their use as pesticides CBR1, CBR3, CYP1B1 GAA 4838/4885MEN1 4081/4885KMT2A 3057/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.